4-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylamino]butanoic acid

Systemtic Name: 4-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylamino]butanoic acid Openeye Name: 4-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methylamino]butanoic acid CAS Name: 4-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methylamino]butanoic acid IUPAC Name: 4-[(5-chloro-1,3-dimethylpyrazol-4-yl)methylamino]butanoic acid Traditional Name: 4-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methylamino]butyric acid Formula: C10H16ClN3O2 MolecularWeight: 245.70594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CNCCCC(=O)O)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CNCCCC(=O)O)Cl)C

InChI

InChI=1S/C10H16ClN3O2/c1-7-8(10(11)14(2)13-7)6-12-5-3-4-9(15)16/h12H,3-6H2,1-2H3,(H,15,16)